Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 7/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 4/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.35 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.35 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | HTR2C | P28335 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
| ▸ | HRH1 | P35367 | 1/20 | 0.35 |
| ▸ | DRD3 | P35462 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.34 |
| ▸ | SLC1A2 | P43004 | 2/20 | 0.34 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL23315005 | 0.97 | CA2 (0.41) | CA2MAPK1CA1SLC1A2SLC1A1 | |
| SCHEMBL24304106 | 0.92 | CA2 (0.46) | CA2MAPK1CA1SLC1A2SLC1A1 | |
| SCHEMBL21482374 | 0.92 | CA2 (0.46) | CA2MAPK1CA1SLC1A2SLC1A1 | |
| SCHEMBL20711871 | 0.92 | CA2 (0.41) | CA2MAPK1CA1SLC1A2SLC1A1 | |
| SCHEMBL22198721 | 0.90 | CA2 (0.43) | CA2SLC1A2SLC1A1GRIK1GRIK2 | |
| SCHEMBL24462639 | 0.90 | CA2 (0.43) | CA2SLC1A2SLC1A1GRIK1GRIK2 | |
| SCHEMBL21482210 | 0.90 | CA2 (0.43) | CA2SLC1A2SLC1A1GRIK1GRIK2 | |
| SCHEMBL21486156 | 0.90 | CA2 (0.43) | CA2SLC1A2SLC1A1GRIK1GRIK2 | |
| SCHEMBL19970124 | 0.86 | CHRM1 (0.38) | CA2MAPK1CA1CHRM1AKR1A1 | |
| SCHEMBL18909689 | 0.84 | CA2 (0.41) | CA2MAPK1CA1GRIK1GRIK2 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2018049233-A9 | INHIBITORS OF THE FIBROBLAST GROWTH FACTOR RECEPTOR 4 IN COMBINATION WITH CYCLIN-DEPENDENT KINASE INHIBITORS | STRANSKY NICOLAS (US) | 2018-07-12 | — | — | WO | disclosed |
| WO-2018049233-A1 | INHIBITORS OF THE FIBROBLAST GROWTH FACTOR RECEPTOR IN COMBINATION WITH CYCLIN-DEPENDENT KINASE INHIBITORS | STRANSKY NICOLAS (US) | 2018-03-15 | — | — | WO | disclosed |